3-[1,3-benzodioxol-5-yl(pyrrolidin-1-yl)methyl]-2-oxidanyl-chromen-4-one

Systemtic Name: 3-[1,3-benzodioxol-5-yl(pyrrolidin-1-yl)methyl]-2-oxidanyl-chromen-4-one Openeye Name: 3-[1,3-benzodioxol-5-yl(pyrrolidin-1-yl)methyl]-2-hydroxy-chromen-4-one CAS Name: 3-[1,3-benzodioxol-5-yl(1-pyrrolidinyl)methyl]-2-hydroxy-1-benzopyran-4-one IUPAC Name: 3-[1,3-benzodioxol-5-yl(pyrrolidin-1-yl)methyl]-2-hydroxychromen-4-one Traditional Name: 3-[1,3-benzodioxol-5-yl(pyrrolidino)methyl]-2-hydroxy-chromone Formula: C21H19NO5 MolecularWeight: 365.37926

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(C2=CC3=C(C=C2)OCO3)C4=C(OC5=CC=CC=C5C4=O)O

Isomeric SMILES

C1CCN(C1)C(C2=CC3=C(C=C2)OCO3)C4=C(OC5=CC=CC=C5C4=O)O

InChI

InChI=1S/C21H19NO5/c23-20-14-5-1-2-6-15(14)27-21(24)18(20)19(22-9-3-4-10-22)13-7-8-16-17(11-13)26-12-25-16/h1-2,5-8,11,19,24H,3-4,9-10,12H2